Isobutyronitrile

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Properties Simple | Detailed

Formula C4H7N
IUPAC Name 2-methylpropanenitrile
Molecular Mass 69.105 g·mol−1
Heat of Formation 33.3 ± 16.7 kJ·mol−1
Dipole Moment 3.97 ± 1.08 D
Volume 105.89 Å 3
Surface Area 119.57 Å 2
HOMO Energy -12.16 ± 0.55 eV
LUMO Energy 4.25 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-cyano-1-methylethane
  • 2-cyanopropane
  • 2-methylpropane nitrile
  • 2-methylpropionitrile
  • alpha-methylpropanenitrile
  • dimethylacetonitrile
  • isobutyronitrile [un2284] [flammable liquid]
  • isopropyl cyanide
  • isopropyl nitrile
  • isopropylnitrile
  • propanenitrile, 2-methyl-
  • propanoic acid, 2-methyl-, nitrile
CAS Number(s)
  • 78-82-0
InChIKey LRDFRRGEGBBSRN-UHFFFAOYSA-N
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Elements H C N